N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[(3-fluorophenyl)methyl-methyl-amino]propanamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[(3-fluorophenyl)methyl-methyl-amino]propanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-[(3-fluorophenyl)methyl-methyl-amino]propanamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-[(3-fluorophenyl)methyl-methylamino]propanamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[(3-fluorophenyl)methyl-methylamino]propanamide Traditional Name: 2-[(3-fluorobenzyl)-methyl-amino]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)propionamide Formula: C22H25FN4O2 MolecularWeight: 396.457903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(C)N(C)CC3=CC(=CC=C3)F

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(C)N(C)CC3=CC(=CC=C3)F

InChI

InChI=1S/C22H25FN4O2/c1-15-20(22(29)27(26(15)4)19-11-6-5-7-12-19)24-21(28)16(2)25(3)14-17-9-8-10-18(23)13-17/h5-13,16H,14H2,1-4H3,(H,24,28)